1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one

C23H22N4O — CID 44583647

IUPAC1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one
SMILESCc1nc2c(N[C@@H]3CCc4ccccc43)cc(-n3ccccc3=O)cn2c1C
InChIInChI=1S/C23H22N4O/c1-15-16(2)27-14-18(26-12-6-5-9-22(26)28)13-21(23(27)24-15)25-20-11-10-17-7-3-4-8-19(17)20/h3-9,12-14,20,25H,10-11H2,1-2H3/t20-/m1/s1
InChIKeyOLCABARHEDJPQC-HXUWFJFHSA-N
MW370.46 g/mol
LogP4.20
Rot. Bonds3

About 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one

1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one (PubChem CID 44583647) has the molecular formula C23H22N4O and a molecular weight of 370.46 g/mol. Its IUPAC name is 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one.

Molecular Properties

Compound Name1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one
PubChem CID44583647
Molecular FormulaC23H22N4O
Molecular Weight370.46 g/mol
Exact Mass370.18
IUPAC Name1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one
SMILESCc1nc2c(N[C@@H]3CCc4ccccc43)cc(-n3ccccc3=O)cn2c1C
InChIInChI=1S/C23H22N4O/c1-15-16(2)27-14-18(26-12-6-5-9-22(26)28)13-21(23(27)24-15)25-20-11-10-17-7-3-4-8-19(17)20/h3-9,12-14,20,25H,10-11H2,1-2H3/t20-/m1/s1
InChIKeyOLCABARHEDJPQC-HXUWFJFHSA-N
XLogP4.20
TPSA51.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one?
The IUPAC name of 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one (CID 44583647) is 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one.
What is the SMILES notation for 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one?
The canonical SMILES for 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one is Cc1nc2c(N[C@@H]3CCc4ccccc43)cc(-n3ccccc3=O)cn2c1C.
What is the InChIKey of 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one?
The InChIKey is OLCABARHEDJPQC-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H22N4O/c1-15-16(2)27-14-18(26-12-6-5-9-22(26)28)13-21(23(27)24-15)25-20-11-10-17-7-3-4-8-19(17)20/h3-9,12-14,20,25H,10-11H2,1-2H3/t20-/m1/s1.
What are the key properties of 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one?
1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one has a molecular weight of 370.46 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one is sourced from PubChem (CID 44583647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).